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Compile Data Set for Download or QSAR

Found 11 hits of ph data with Target = 'Transcription Factor STAT1'   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kJ/mole
IC50
nM
Kd
nM
EC50/IC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
Transcription Factor STAT1


(Homo sapiens (human))
BDBM20273
PNG
((2S)-2-[(2S)-2-[(4-cyanophenyl)formamido]-3-[4-(ph...)
Show SMILES CC(C)C[C@H](NC(=O)[C@H](Cc1ccc(OP(O)(O)=O)cc1)NC(=O)c1ccc(cc1)C#N)C(O)=O
Show InChI InChI=1S/C23H26N3O8P/c1-14(2)11-20(23(29)30)26-22(28)19(25-21(27)17-7-3-16(13-24)4-8-17)12-15-5-9-18(10-6-15)34-35(31,32)33/h3-10,14,19-20H,11-12H2,1-2H3,(H,25,27)(H,26,28)(H,29,30)(H2,31,32,33)/t19-,20-/m0/s1
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n/an/a 3.10E+5n/an/an/an/a7.822



Yale University



Assay Description
STAT proteins were expressed in Sf9 cells from a baculovirus encoding the recombinant protein. A nuclear extract of the Sf9 cells was incubated with ...


Bioorg Med Chem Lett 17: 1875-8 (2007)


Article DOI: 10.1016/j.bmcl.2007.01.077
BindingDB Entry DOI: 10.7270/Q2FB517J
More data for this
Ligand-Target Pair
Transcription Factor STAT1


(Homo sapiens (human))
BDBM20274
PNG
(4-[(2S)-2-[(4-cyanophenyl)formamido]-2-{[(1S)-3-me...)
Show SMILES CC(C)C[C@H](NC(=O)[C@H](Cc1ccc(OP(O)(O)=O)cc1)NC(=O)c1ccc(cc1)C#N)C(=O)NC(C)C
Show InChI InChI=1S/C26H33N4O7P/c1-16(2)13-22(25(32)28-17(3)4)30-26(33)23(29-24(31)20-9-5-19(15-27)6-10-20)14-18-7-11-21(12-8-18)37-38(34,35)36/h5-12,16-17,22-23H,13-14H2,1-4H3,(H,28,32)(H,29,31)(H,30,33)(H2,34,35,36)/t22-,23-/m0/s1
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n/an/a 5.80E+4n/an/an/an/a7.822



Yale University



Assay Description
STAT proteins were expressed in Sf9 cells from a baculovirus encoding the recombinant protein. A nuclear extract of the Sf9 cells was incubated with ...


Bioorg Med Chem Lett 17: 1875-8 (2007)


Article DOI: 10.1016/j.bmcl.2007.01.077
BindingDB Entry DOI: 10.7270/Q2FB517J
More data for this
Ligand-Target Pair
Transcription Factor STAT1


(Homo sapiens (human))
BDBM20275
PNG
(4-[(2S)-2-[(4-cyanophenyl)formamido]-2-{[(1S)-1-[(...)
Show SMILES CC(C)C[C@H](NC(=O)[C@H](Cc1ccc(OP(O)(O)=O)cc1)NC(=O)c1ccc(cc1)C#N)C(=O)NCCCO
Show InChI InChI=1S/C26H33N4O8P/c1-17(2)14-22(25(33)28-12-3-13-31)30-26(34)23(29-24(32)20-8-4-19(16-27)5-9-20)15-18-6-10-21(11-7-18)38-39(35,36)37/h4-11,17,22-23,31H,3,12-15H2,1-2H3,(H,28,33)(H,29,32)(H,30,34)(H2,35,36,37)/t22-,23-/m0/s1
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n/an/a 6.20E+5n/an/an/an/a7.822



Yale University



Assay Description
STAT proteins were expressed in Sf9 cells from a baculovirus encoding the recombinant protein. A nuclear extract of the Sf9 cells was incubated with ...


Bioorg Med Chem Lett 17: 1875-8 (2007)


Article DOI: 10.1016/j.bmcl.2007.01.077
BindingDB Entry DOI: 10.7270/Q2FB517J
More data for this
Ligand-Target Pair
Transcription Factor STAT1


(Homo sapiens (human))
BDBM20276
PNG
(4-[(2S)-2-[(4-cyanophenyl)formamido]-2-{[(1S)-1-(c...)
Show SMILES CC(C)C[C@H](NC(=O)[C@H](Cc1ccc(OP(O)(O)=O)cc1)NC(=O)c1ccc(cc1)C#N)C(=O)NC1CCCCC1
Show InChI InChI=1S/C29H37N4O7P/c1-19(2)16-25(28(35)31-23-6-4-3-5-7-23)33-29(36)26(32-27(34)22-12-8-21(18-30)9-13-22)17-20-10-14-24(15-11-20)40-41(37,38)39/h8-15,19,23,25-26H,3-7,16-17H2,1-2H3,(H,31,35)(H,32,34)(H,33,36)(H2,37,38,39)/t25-,26-/m0/s1
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n/an/a 5.80E+4n/an/an/an/a7.822



Yale University



Assay Description
STAT proteins were expressed in Sf9 cells from a baculovirus encoding the recombinant protein. A nuclear extract of the Sf9 cells was incubated with ...


Bioorg Med Chem Lett 17: 1875-8 (2007)


Article DOI: 10.1016/j.bmcl.2007.01.077
BindingDB Entry DOI: 10.7270/Q2FB517J
More data for this
Ligand-Target Pair
Transcription Factor STAT1


(Homo sapiens (human))
BDBM20277
PNG
(4-[(2S)-2-[(4-cyanophenyl)formamido]-2-{[(1S)-3-me...)
Show SMILES CC(C)C[C@H](NC(=O)[C@H](Cc1ccc(OP(O)(O)=O)cc1)NC(=O)c1ccc(cc1)C#N)C(=O)Nc1ccccc1
Show InChI InChI=1S/C29H31N4O7P/c1-19(2)16-25(28(35)31-23-6-4-3-5-7-23)33-29(36)26(32-27(34)22-12-8-21(18-30)9-13-22)17-20-10-14-24(15-11-20)40-41(37,38)39/h3-15,19,25-26H,16-17H2,1-2H3,(H,31,35)(H,32,34)(H,33,36)(H2,37,38,39)/t25-,26-/m0/s1
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n/an/a 3.10E+5n/an/an/an/a7.822



Yale University



Assay Description
STAT proteins were expressed in Sf9 cells from a baculovirus encoding the recombinant protein. A nuclear extract of the Sf9 cells was incubated with ...


Bioorg Med Chem Lett 17: 1875-8 (2007)


Article DOI: 10.1016/j.bmcl.2007.01.077
BindingDB Entry DOI: 10.7270/Q2FB517J
More data for this
Ligand-Target Pair
Transcription Factor STAT1


(Homo sapiens (human))
BDBM20283
PNG
(2-hydroxy-4-(2-{[(4-methylbenzene)sulfonyl]oxy}ace...)
Show SMILES Cc1ccc(cc1)S(=O)(=O)OCC(=O)Nc1ccc(C(O)=O)c(O)c1
Show InChI InChI=1S/C16H15NO7S/c1-10-2-5-12(6-3-10)25(22,23)24-9-15(19)17-11-4-7-13(16(20)21)14(18)8-11/h2-8,18H,9H2,1H3,(H,17,19)(H,20,21)
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n/an/a>3.00E+5n/an/an/an/a7.822



University of Central Florida College of Medicine



Assay Description
STAT proteins were expressed in Sf9 cells from a baculovirus encoding the recombinant protein. A nuclear extract of the Sf9 cells was incubated with ...


Proc Natl Acad Sci U S A 104: 7391-6 (2007)


Article DOI: 10.1073/pnas.0609757104
BindingDB Entry DOI: 10.7270/Q25T3HRN
More data for this
Ligand-Target Pair
Transcription Factor STAT1


(Homo sapiens (human))
BDBM20279
PNG
(4-[(2S)-2-[(4-cyanophenyl)formamido]-2-{[(1S)-1-[(...)
Show SMILES COc1cccc(NC(=O)[C@H](CC(C)C)NC(=O)[C@H](Cc2ccc(OP(O)(O)=O)cc2)NC(=O)c2ccc(cc2)C#N)c1
Show InChI InChI=1S/C30H33N4O8P/c1-19(2)15-26(29(36)32-23-5-4-6-25(17-23)41-3)34-30(37)27(33-28(35)22-11-7-21(18-31)8-12-22)16-20-9-13-24(14-10-20)42-43(38,39)40/h4-14,17,19,26-27H,15-16H2,1-3H3,(H,32,36)(H,33,35)(H,34,37)(H2,38,39,40)/t26-,27-/m0/s1
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n/an/a 3.10E+4n/an/an/an/a7.822



Yale University



Assay Description
STAT proteins were expressed in Sf9 cells from a baculovirus encoding the recombinant protein. A nuclear extract of the Sf9 cells was incubated with ...


Bioorg Med Chem Lett 17: 1875-8 (2007)


Article DOI: 10.1016/j.bmcl.2007.01.077
BindingDB Entry DOI: 10.7270/Q2FB517J
More data for this
Ligand-Target Pair
Transcription Factor STAT1


(Homo sapiens (human))
BDBM20280
PNG
(4-[(2S)-2-[(4-cyanophenyl)formamido]-2-{[(1S)-3-me...)
Show SMILES CC(C)CNC(=O)[C@H](CC(C)C)NC(=O)[C@H](Cc1ccc(OP(O)(O)=O)cc1)NC(=O)c1ccc(cc1)C#N
Show InChI InChI=1S/C27H35N4O7P/c1-17(2)13-23(26(33)29-16-18(3)4)31-27(34)24(30-25(32)21-9-5-20(15-28)6-10-21)14-19-7-11-22(12-8-19)38-39(35,36)37/h5-12,17-18,23-24H,13-14,16H2,1-4H3,(H,29,33)(H,30,32)(H,31,34)(H2,35,36,37)/t23-,24-/m0/s1
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n/an/a 7.40E+4n/an/an/an/a7.822



Yale University



Assay Description
STAT proteins were expressed in Sf9 cells from a baculovirus encoding the recombinant protein. A nuclear extract of the Sf9 cells was incubated with ...


Bioorg Med Chem Lett 17: 1875-8 (2007)


Article DOI: 10.1016/j.bmcl.2007.01.077
BindingDB Entry DOI: 10.7270/Q2FB517J
More data for this
Ligand-Target Pair
Transcription Factor STAT1


(Homo sapiens (human))
BDBM20281
PNG
(4-[(2S)-2-[(4-cyanophenyl)formamido]-2-{[(1S)-3-me...)
Show SMILES CC(C)C[C@H](NC(=O)[C@H](Cc1ccc(OP(O)(O)=O)cc1)NC(=O)c1ccc(cc1)C#N)C(=O)NCc1ccncc1
Show InChI InChI=1S/C29H32N5O7P/c1-19(2)15-25(28(36)32-18-22-11-13-31-14-12-22)34-29(37)26(33-27(35)23-7-3-21(17-30)4-8-23)16-20-5-9-24(10-6-20)41-42(38,39)40/h3-14,19,25-26H,15-16,18H2,1-2H3,(H,32,36)(H,33,35)(H,34,37)(H2,38,39,40)/t25-,26-/m0/s1
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n/an/a 1.23E+5n/an/an/an/a7.822



Yale University



Assay Description
STAT proteins were expressed in Sf9 cells from a baculovirus encoding the recombinant protein. A nuclear extract of the Sf9 cells was incubated with ...


Bioorg Med Chem Lett 17: 1875-8 (2007)


Article DOI: 10.1016/j.bmcl.2007.01.077
BindingDB Entry DOI: 10.7270/Q2FB517J
More data for this
Ligand-Target Pair
Transcription Factor STAT1


(Homo sapiens (human))
BDBM20282
PNG
(4-{[4-(hexylcarbamoyl)-2-(naphthalen-1-yl)-1,3-oxa...)
Show SMILES CCCCCCNC(=O)c1nc(oc1Cc1ccc(OP(O)(O)=O)cc1)-c1cccc2ccccc12
Show InChI InChI=1S/C27H29N2O6P/c1-2-3-4-7-17-28-26(30)25-24(18-19-13-15-21(16-14-19)35-36(31,32)33)34-27(29-25)23-12-8-10-20-9-5-6-11-22(20)23/h5-6,8-16H,2-4,7,17-18H2,1H3,(H,28,30)(H2,31,32,33)
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n/an/a 1.59E+5n/an/an/an/a7.822



University of Central Florida College of Medicine



Assay Description
STAT proteins were expressed in Sf9 cells from a baculovirus encoding the recombinant protein. A nuclear extract of the Sf9 cells was incubated with ...


ACS Chem Biol 2: 787-98 (2007)


Article DOI: 10.1021/cb7001973
BindingDB Entry DOI: 10.7270/Q29K48HT
More data for this
Ligand-Target Pair
Transcription Factor STAT1


(Homo sapiens (human))
BDBM20278
PNG
(4-[(2S)-2-{[(1S)-1-(benzylcarbamoyl)-3-methylbutyl...)
Show SMILES CC(C)C[C@H](NC(=O)[C@H](Cc1ccc(OP(O)(O)=O)cc1)NC(=O)c1ccc(cc1)C#N)C(=O)NCc1ccccc1
Show InChI InChI=1S/C30H33N4O7P/c1-20(2)16-26(29(36)32-19-23-6-4-3-5-7-23)34-30(37)27(33-28(35)24-12-8-22(18-31)9-13-24)17-21-10-14-25(15-11-21)41-42(38,39)40/h3-15,20,26-27H,16-17,19H2,1-2H3,(H,32,36)(H,33,35)(H,34,37)(H2,38,39,40)/t26-,27-/m0/s1
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n/an/a 8.00E+5n/an/an/an/a7.822



Yale University



Assay Description
STAT proteins were expressed in Sf9 cells from a baculovirus encoding the recombinant protein. A nuclear extract of the Sf9 cells was incubated with ...


Bioorg Med Chem Lett 17: 1875-8 (2007)


Article DOI: 10.1016/j.bmcl.2007.01.077
BindingDB Entry DOI: 10.7270/Q2FB517J
More data for this
Ligand-Target Pair